G2 and G3 Calculations of Enthalpies of Hydrogenation, Isomerization, and Formation of Bi-, Tri-, and Tetracyclic C7 Hydrocarbons: The Norbornadiene Cycle
- 1 October 1999
- journal article
- Published by American Chemical Society (ACS) in The Journal of Physical Chemistry A
- Vol. 103 (43) , 8733-8737
- https://doi.org/10.1021/jp992093g
Abstract
No abstract availableThis publication has 19 references indexed in Scilit:
- G2(MP2) and G2(MP2,SVP) Calculations of Enthalpies of Hydrogenation, Isomerization, and Formation of C5 Hydrocarbons. 2. Substituted Cyclobutenes, Vinylcyclopropene, Spiropentane, and MethyltetrahedraneThe Journal of Physical Chemistry A, 1998
- Accurate density functional thermochemistry for larger moleculesMolecular Physics, 1997
- Ab Initio Calculations of Enthalpies of Hydrogenation, Isomerization, and Formation of Cyclic C5 HydrocarbonsThe Journal of Physical Chemistry A, 1997
- G2 ab Initio Calculations of the Enthalpies of Formation of C3 HydrocarbonsThe Journal of Physical Chemistry, 1995
- Triplet Species from Norbornadiene. Time-Resolved Photoacoustic Calorimetry and ab Initio Studies of Energy, Geometry, and Spin-Orbit CouplingJournal of the American Chemical Society, 1995
- Density-functional exchange-energy approximation with correct asymptotic behaviorPhysical Review A, 1988
- Heats of hydrogenation and formation of quadricyclene, nortornadiene, nortornene, and nortricycleneThe Journal of Physical Chemistry, 1980
- Thermochemistry, thermodynamic functions, and molecular structures of some cyclic hydrocarbonsThe Journal of Physical Chemistry, 1971
- Fluorine-19 hyperfine splittings in the electron spin resonance spectra of fluorinated aromatic free radicals. II. Triphenylmethyl radicalsJournal of the American Chemical Society, 1970
- 712. Heats of combustion and molecular structure. Part IX. Bicyclo[2,2,1]heptane, 7-oxabicyclo[2,2,1]heptane, and exo- and endo-2-methyl-7-oxabicyclo[2,2,1]heptaneJournal of the Chemical Society, 1963